NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | program | type | subtype | subsubtype |
|
|
591405 |
2mx1   |
25381 | cing | 4-filtered-FRED | Wattos | check | violation | dihedral angle |
data_2mx1
save_dihedral_constraint_statistics_1
_TA_constraint_stats_list.Sf_category torsion_angle_constraint_statistics
_TA_constraint_stats_list.Constraint_count 187
_TA_constraint_stats_list.Viol_count 499
_TA_constraint_stats_list.Viol_total 14260.95
_TA_constraint_stats_list.Viol_max 5.58
_TA_constraint_stats_list.Viol_rms 0.63
_TA_constraint_stats_list.Viol_average_all_restraints 0.19
_TA_constraint_stats_list.Viol_average_violations_only 1.43
_TA_constraint_stats_list.Cutoff_violation_report 5.00
_TA_constraint_stats_list.Details
;
Description of the tags in this list:
* 1 * Administrative tag
* 2 * ID of the restraint list.
* 3 * Number of restraints in list.
* 4 * Number of violated restraints (each model violation is used).
* 5 * Sum of violations in degrees.
* 6 * Maximum violation of a restraint without averaging in any way.
* 7 * Rms of violations over all restraints.
* 8 * Average violation over all restraints.
* 9 * Average violation over violated restraints.
This violation is averaged over only those models in which the restraint is violated.
Threshold for reporting violations (degrees) in the last columns of the next table.
* 10 * This tag.
Description of the tags in the per restraint table below:
* 1 * Restraint ID within restraint list.
* 2 * Torsion angle name where available.
* 3 * First atom's:
* 4 * Chain identifier (can be absent if none defined)
* 5 * Residue number
* 6 * Residue name
* 7 * Name of (pseudo-)atom
* 8 * Second thru fourth atom's identifiers occupy columns 7 thru 18.
* 19 * Lower bound (degrees)
* 20 * Upper bound (degrees)
* 21 * Average angle in ensemble of models
* 22 * Minimum angle in ensemble of models (counter clockwise from range)
* 23 * Maximum angle in ensemble of models (clockwise from range)
* 24 * Maximum violation (without any averaging)
* 25 * Model number with the maximum violation
* 26 * Number of models with a violation above cutoff
* 27 * List of models with a violation above cutoff. See description above.
* 28 * Administrative tag
* 29 * Administrative tag
;
loop_
_TA_constraint_stats.Restraint_ID
_TA_constraint_stats.Torsion_angle_name
_TA_constraint_stats.Entity_assembly_ID_1
_TA_constraint_stats.Comp_index_ID_1
_TA_constraint_stats.Comp_ID_1
_TA_constraint_stats.Atom_ID_1
_TA_constraint_stats.Entity_assembly_ID_2
_TA_constraint_stats.Comp_index_ID_2
_TA_constraint_stats.Comp_ID_2
_TA_constraint_stats.Atom_ID_2
_TA_constraint_stats.Entity_assembly_ID_3
_TA_constraint_stats.Comp_index_ID_3
_TA_constraint_stats.Comp_ID_3
_TA_constraint_stats.Atom_ID_3
_TA_constraint_stats.Entity_assembly_ID_4
_TA_constraint_stats.Comp_index_ID_4
_TA_constraint_stats.Comp_ID_4
_TA_constraint_stats.Atom_ID_4
_TA_constraint_stats.Angle_lower_bound_val
_TA_constraint_stats.Angle_upper_bound_val
_TA_constraint_stats.Angle_average
_TA_constraint_stats.Angle_minimum
_TA_constraint_stats.Angle_maximum
_TA_constraint_stats.Max_violation
_TA_constraint_stats.Max_violation_model_number
_TA_constraint_stats.Over_cutoff_violation_count
_TA_constraint_stats.Over_cutoff_violation_per_model
1 . 1 5 GLN N 1 5 GLN CA 1 5 GLN C 1 6 ARG N -52.00 -32.00 -41.99 -49.60 -35.35 . . 0 "[ . 1 . 2]"
2 . 1 4 LEU C 1 5 GLN N 1 5 GLN CA 1 5 GLN C -69.00 -49.00 -63.82 -67.96 -60.88 . . 0 "[ . 1 . 2]"
3 . 1 6 ARG N 1 6 ARG CA 1 6 ARG C 1 7 ASP N -49.00 -29.00 -41.10 -43.61 -38.11 . . 0 "[ . 1 . 2]"
4 . 1 5 GLN C 1 6 ARG N 1 6 ARG CA 1 6 ARG C -74.00 -54.00 -63.06 -64.72 -65.56 . . 0 "[ . 1 . 2]"
5 . 1 7 ASP N 1 7 ASP CA 1 7 ASP C 1 8 ALA N -49.00 -29.00 -44.85 -46.38 -46.99 . . 0 "[ . 1 . 2]"
6 . 1 6 ARG C 1 7 ASP N 1 7 ASP CA 1 7 ASP C -78.00 -50.00 -61.77 -70.97 -59.09 . . 0 "[ . 1 . 2]"
7 . 1 8 ALA N 1 8 ALA CA 1 8 ALA C 1 9 ILE N -48.00 -32.00 -45.94 -45.61 -45.87 1.23 16 0 "[ . 1 . 2]"
8 . 1 7 ASP C 1 8 ALA N 1 8 ALA CA 1 8 ALA C -76.00 -56.00 -62.23 -64.54 -60.20 . . 0 "[ . 1 . 2]"
9 . 1 9 ILE N 1 9 ILE CA 1 9 ILE C 1 10 ALA N -51.00 -27.00 -43.26 -43.72 -43.76 . . 0 "[ . 1 . 2]"
10 . 1 8 ALA C 1 9 ILE N 1 9 ILE CA 1 9 ILE C -80.00 -52.00 -63.71 -67.35 -62.90 . . 0 "[ . 1 . 2]"
11 . 1 10 ALA N 1 10 ALA CA 1 10 ALA C 1 11 ALA N -50.00 -34.00 -44.03 -45.59 -46.42 . . 0 "[ . 1 . 2]"
12 . 1 9 ILE C 1 10 ALA N 1 10 ALA CA 1 10 ALA C -68.00 -56.00 -57.29 -56.90 -57.07 0.54 19 0 "[ . 1 . 2]"
13 . 1 11 ALA N 1 11 ALA CA 1 11 ALA C 1 12 ALA N -49.00 -25.00 -44.05 -41.73 -42.76 . . 0 "[ . 1 . 2]"
14 . 1 10 ALA C 1 11 ALA N 1 11 ALA CA 1 11 ALA C -80.00 -60.00 -62.85 -62.17 -62.48 . . 0 "[ . 1 . 2]"
15 . 1 12 ALA N 1 12 ALA CA 1 12 ALA C 1 13 ILE N -58.00 -26.00 -52.84 -55.24 -50.57 . . 0 "[ . 1 . 2]"
16 . 1 11 ALA C 1 12 ALA N 1 12 ALA CA 1 12 ALA C -80.00 -56.00 -60.49 -62.78 -59.34 . . 0 "[ . 1 . 2]"
17 . 1 13 ILE N 1 13 ILE CA 1 13 ILE C 1 14 ASP N -53.00 -29.00 -37.53 -31.01 -33.43 1.51 7 0 "[ . 1 . 2]"
18 . 1 12 ALA C 1 13 ILE N 1 13 ILE CA 1 13 ILE C -72.00 -56.00 -68.83 -71.59 -66.75 . . 0 "[ . 1 . 2]"
19 . 1 14 ASP N 1 14 ASP CA 1 14 ASP C 1 15 VAL N -55.00 -23.00 -53.64 -55.08 -55.13 1.20 6 0 "[ . 1 . 2]"
20 . 1 13 ILE C 1 14 ASP N 1 14 ASP CA 1 14 ASP C -74.00 -54.00 -58.38 -60.95 -56.59 . . 0 "[ . 1 . 2]"
21 . 1 15 VAL N 1 15 VAL CA 1 15 VAL C 1 16 LEU N -56.00 -32.00 -39.84 -40.69 -38.37 . . 0 "[ . 1 . 2]"
22 . 1 14 ASP C 1 15 VAL N 1 15 VAL CA 1 15 VAL C -83.00 -51.00 -62.32 -64.59 -59.75 . . 0 "[ . 1 . 2]"
23 . 1 16 LEU N 1 16 LEU CA 1 16 LEU C 1 17 ASN N -60.00 -12.00 -50.51 -50.28 -50.40 . . 0 "[ . 1 . 2]"
24 . 1 15 VAL C 1 16 LEU N 1 16 LEU CA 1 16 LEU C -81.00 -53.00 -52.55 -52.28 -52.38 1.39 10 0 "[ . 1 . 2]"
25 . 1 17 ASN N 1 17 ASN CA 1 17 ASN C 1 18 GLU N -54.00 10.00 -50.27 -50.62 -50.99 . . 0 "[ . 1 . 2]"
26 . 1 16 LEU C 1 17 ASN N 1 17 ASN CA 1 17 ASN C -96.00 -44.00 -79.70 -79.95 -80.20 . . 0 "[ . 1 . 2]"
27 . 1 19 GLU C 1 20 ARG N 1 20 ARG CA 1 20 ARG C -163.00 -79.00 -159.38 -164.80 -149.88 1.80 8 0 "[ . 1 . 2]"
28 . 1 21 VAL N 1 21 VAL CA 1 21 VAL C 1 22 ILE N 113.00 177.00 139.62 142.63 140.92 . . 0 "[ . 1 . 2]"
29 . 1 22 ILE N 1 22 ILE CA 1 22 ILE C 1 23 ALA N 142.00 178.00 165.86 162.92 168.25 . . 0 "[ . 1 . 2]"
30 . 1 21 VAL C 1 22 ILE N 1 22 ILE CA 1 22 ILE C -154.00 -102.00 -128.05 -129.87 -130.44 . . 0 "[ . 1 . 2]"
31 . 1 23 ALA N 1 23 ALA CA 1 23 ALA C 1 24 TYR N 126.00 174.00 133.83 127.14 141.88 . . 0 "[ . 1 . 2]"
32 . 1 22 ILE C 1 23 ALA N 1 23 ALA CA 1 23 ALA C 151.00 -33.00 -62.94 -65.77 -58.58 . . 0 "[ . 1 . 2]"
33 . 1 24 TYR N 1 24 TYR CA 1 24 TYR C 1 25 PRO N 33.00 -171.00 141.09 138.25 133.63 . . 0 "[ . 1 . 2]"
34 . 1 23 ALA C 1 24 TYR N 1 24 TYR CA 1 24 TYR C -158.00 -58.00 -125.41 -126.66 -127.96 . . 0 "[ . 1 . 2]"
35 . 1 29 VAL N 1 29 VAL CA 1 29 VAL C 1 30 PHE N 110.00 -148.00 128.02 123.57 132.22 . . 0 "[ . 1 . 2]"
36 . 1 28 ALA C 1 29 VAL N 1 29 VAL CA 1 29 VAL C 104.00 -36.00 -127.23 -125.77 -126.59 . . 0 "[ . 1 . 2]"
37 . 1 30 PHE N 1 30 PHE CA 1 30 PHE C 1 31 GLY N 49.00 -127.00 144.17 142.60 140.39 . . 0 "[ . 1 . 2]"
38 . 1 29 VAL C 1 30 PHE N 1 30 PHE CA 1 30 PHE C -149.00 -37.00 -44.85 -60.67 -36.77 0.23 17 0 "[ . 1 . 2]"
39 . 1 30 PHE C 1 31 GLY N 1 31 GLY CA 1 31 GLY C -162.00 -70.00 -151.22 -160.99 -137.74 . . 0 "[ . 1 . 2]"
40 . 1 32 VAL N 1 32 VAL CA 1 32 VAL C 1 33 GLY N 143.00 179.00 169.35 166.68 165.43 . . 0 "[ . 1 . 2]"
41 . 1 31 GLY C 1 32 VAL N 1 32 VAL CA 1 32 VAL C -158.00 -102.00 -131.04 -128.19 -129.72 . . 0 "[ . 1 . 2]"
42 . 1 33 GLY C 1 34 CYS N 1 34 CYS CA 1 34 CYS C -173.00 -113.00 -157.06 -154.66 -155.45 . . 0 "[ . 1 . 2]"
43 . 1 39 GLU N 1 39 GLU CA 1 39 GLU C 1 40 THR N -70.00 2.00 -32.17 -36.46 -17.92 . . 0 "[ . 1 . 2]"
44 . 1 38 SER C 1 39 GLU N 1 39 GLU CA 1 39 GLU C -71.00 -43.00 -68.58 -71.65 -65.02 0.65 14 0 "[ . 1 . 2]"
45 . 1 40 THR N 1 40 THR CA 1 40 THR C 1 41 ALA N -65.00 -5.00 -42.03 -46.49 -28.04 . . 0 "[ . 1 . 2]"
46 . 1 39 GLU C 1 40 THR N 1 40 THR CA 1 40 THR C -76.00 -44.00 -60.99 -65.20 -43.48 0.52 8 0 "[ . 1 . 2]"
47 . 1 41 ALA N 1 41 ALA CA 1 41 ALA C 1 42 VAL N -53.00 -33.00 -51.11 -50.61 -51.23 . . 0 "[ . 1 . 2]"
48 . 1 40 THR C 1 41 ALA N 1 41 ALA CA 1 41 ALA C -72.00 -52.00 -59.37 -64.30 -55.78 . . 0 "[ . 1 . 2]"
49 . 1 42 VAL N 1 42 VAL CA 1 42 VAL C 1 43 MET N -62.00 -22.00 -44.14 -45.33 -45.73 . . 0 "[ . 1 . 2]"
50 . 1 41 ALA C 1 42 VAL N 1 42 VAL CA 1 42 VAL C -81.00 -49.00 -63.22 -63.07 -63.62 . . 0 "[ . 1 . 2]"
51 . 1 43 MET N 1 43 MET CA 1 43 MET C 1 44 ARG N -53.00 -21.00 -42.63 -41.44 -45.04 . . 0 "[ . 1 . 2]"
52 . 1 42 VAL C 1 43 MET N 1 43 MET CA 1 43 MET C -70.00 -50.00 -65.10 -66.11 -66.41 . . 0 "[ . 1 . 2]"
53 . 1 44 ARG N 1 44 ARG CA 1 44 ARG C 1 45 LEU N -52.00 -27.00 -35.29 -42.54 -28.70 . . 0 "[ . 1 . 2]"
54 . 1 43 MET C 1 44 ARG N 1 44 ARG CA 1 44 ARG C -72.00 -56.00 -62.03 -62.39 -62.75 . . 0 "[ . 1 . 2]"
55 . 1 45 LEU N 1 45 LEU CA 1 45 LEU C 1 46 LEU N -61.00 -25.00 -57.13 -59.93 -60.39 0.89 19 0 "[ . 1 . 2]"
56 . 1 44 ARG C 1 45 LEU N 1 45 LEU CA 1 45 LEU C -77.00 -57.00 -70.97 -66.57 -70.71 . . 0 "[ . 1 . 2]"
57 . 1 45 LEU C 1 46 LEU N 1 46 LEU CA 1 46 LEU C -76.00 -52.00 -61.23 -78.49 -51.63 2.49 18 0 "[ . 1 . 2]"
58 . 1 46 LEU C 1 47 GLU N 1 47 GLU CA 1 47 GLU C -78.00 -54.00 -67.22 -70.32 -61.49 . . 0 "[ . 1 . 2]"
59 . 1 48 LEU N 1 48 LEU CA 1 48 LEU C 1 49 LYS N -55.00 -15.00 -34.51 -37.56 -32.47 . . 0 "[ . 1 . 2]"
60 . 1 47 GLU C 1 48 LEU N 1 48 LEU CA 1 48 LEU C -74.00 -50.00 -76.15 -78.68 -71.70 4.68 11 0 "[ . 1 . 2]"
61 . 1 48 LEU C 1 49 LYS N 1 49 LYS CA 1 49 LYS C -124.00 -64.00 -75.76 -76.51 -76.95 . . 0 "[ . 1 . 2]"
62 . 1 53 VAL N 1 53 VAL CA 1 53 VAL C 1 54 ASP N -53.00 -13.00 -46.77 -45.47 -45.97 . . 0 "[ . 1 . 2]"
63 . 1 52 PRO C 1 53 VAL N 1 53 VAL CA 1 53 VAL C -74.00 -42.00 -44.08 -47.35 -41.42 0.58 19 0 "[ . 1 . 2]"
64 . 1 54 ASP N 1 54 ASP CA 1 54 ASP C 1 55 LYS N -51.00 13.00 -41.76 -41.87 -42.29 . . 0 "[ . 1 . 2]"
65 . 1 53 VAL C 1 54 ASP N 1 54 ASP CA 1 54 ASP C -87.00 -55.00 -66.83 -65.62 -66.28 . . 0 "[ . 1 . 2]"
66 . 1 55 LYS N 1 55 LYS CA 1 55 LYS C 1 56 GLY N -48.00 16.00 -39.18 -39.26 -39.52 . . 0 "[ . 1 . 2]"
67 . 1 54 ASP C 1 55 LYS N 1 55 LYS CA 1 55 LYS C -123.00 -51.00 -60.85 -62.55 -58.90 . . 0 "[ . 1 . 2]"
68 . 1 57 LEU N 1 57 LEU CA 1 57 LEU C 1 58 ILE N 116.00 -159.00 -164.51 -166.14 -167.55 0.65 4 0 "[ . 1 . 2]"
69 . 1 58 ILE N 1 58 ILE CA 1 58 ILE C 1 59 LEU N 103.00 163.00 142.81 135.16 148.29 . . 0 "[ . 1 . 2]"
70 . 1 57 LEU C 1 58 ILE N 1 58 ILE CA 1 58 ILE C -162.00 -70.00 -104.43 -112.75 -91.14 . . 0 "[ . 1 . 2]"
71 . 1 59 LEU N 1 59 LEU CA 1 59 LEU C 1 60 ILE N 113.00 173.00 143.49 139.29 150.15 . . 0 "[ . 1 . 2]"
72 . 1 58 ILE C 1 59 LEU N 1 59 LEU CA 1 59 LEU C -144.00 -108.00 -117.71 -122.61 -109.02 . . 0 "[ . 1 . 2]"
73 . 1 60 ILE N 1 60 ILE CA 1 60 ILE C 1 61 ALA N 117.00 -179.00 129.92 131.68 131.02 . . 0 "[ . 1 . 2]"
74 . 1 59 LEU C 1 60 ILE N 1 60 ILE CA 1 60 ILE C -151.00 -107.00 -112.17 -120.28 -108.88 . . 0 "[ . 1 . 2]"
75 . 1 61 ALA N 1 61 ALA CA 1 61 ALA C 1 62 ALA N 139.00 175.00 152.55 146.84 159.90 . . 0 "[ . 1 . 2]"
76 . 1 60 ILE C 1 61 ALA N 1 61 ALA CA 1 61 ALA C -174.00 -114.00 -117.83 -123.35 -113.46 0.54 14 0 "[ . 1 . 2]"
77 . 1 64 TYR N 1 64 TYR CA 1 64 TYR C 1 65 GLU N -57.00 -15.00 -14.06 -21.97 -12.53 2.47 14 0 "[ . 1 . 2]"
78 . 1 63 ASN C 1 64 TYR N 1 64 TYR CA 1 64 TYR C -79.00 -43.00 -75.14 -79.98 -58.46 0.98 9 0 "[ . 1 . 2]"
79 . 1 65 GLU N 1 65 GLU CA 1 65 GLU C 1 66 GLN N -64.00 -16.00 -31.91 -32.68 -33.13 . . 0 "[ . 1 . 2]"
80 . 1 64 TYR C 1 65 GLU N 1 65 GLU CA 1 65 GLU C -71.00 -51.00 -51.46 -54.49 -49.60 1.40 14 0 "[ . 1 . 2]"
81 . 1 66 GLN N 1 66 GLN CA 1 66 GLN C 1 67 LEU N -66.00 10.00 -11.71 -15.87 -6.13 . . 0 "[ . 1 . 2]"
82 . 1 65 GLU C 1 66 GLN N 1 66 GLN CA 1 66 GLN C -91.00 -47.00 -94.40 -96.06 -93.12 5.06 16 1 "[ . 1 .+ 2]"
83 . 1 67 LEU N 1 67 LEU CA 1 67 LEU C 1 68 LYS N -35.00 17.00 -16.65 -21.69 -12.33 . . 0 "[ . 1 . 2]"
84 . 1 66 GLN C 1 67 LEU N 1 67 LEU CA 1 67 LEU C -109.00 -69.00 -91.54 -92.94 -89.13 . . 0 "[ . 1 . 2]"
85 . 1 70 TYR N 1 70 TYR CA 1 70 TYR C 1 71 ILE N -63.00 29.00 -11.05 -13.13 -14.48 . . 0 "[ . 1 . 2]"
86 . 1 69 PRO C 1 70 TYR N 1 70 TYR CA 1 70 TYR C -122.00 -70.00 -94.85 -98.25 -87.81 . . 0 "[ . 1 . 2]"
87 . 1 78 ASP N 1 78 ASP CA 1 78 ASP C 1 79 VAL N -49.00 -29.00 -45.78 -49.18 -40.76 0.18 3 0 "[ . 1 . 2]"
88 . 1 77 THR C 1 78 ASP N 1 78 ASP CA 1 78 ASP C -88.00 -40.00 -46.48 -60.36 -38.57 1.43 1 0 "[ . 1 . 2]"
89 . 1 78 ASP C 1 79 VAL N 1 79 VAL CA 1 79 VAL C -69.00 -57.00 -62.25 -63.66 -63.89 . . 0 "[ . 1 . 2]"
90 . 1 80 GLN N 1 80 GLN CA 1 80 GLN C 1 81 ARG N -58.00 -26.00 -40.60 -43.26 -39.03 . . 0 "[ . 1 . 2]"
91 . 1 79 VAL C 1 80 GLN N 1 80 GLN CA 1 80 GLN C -77.00 -57.00 -64.58 -63.48 -64.09 . . 0 "[ . 1 . 2]"
92 . 1 81 ARG N 1 81 ARG CA 1 81 ARG C 1 82 GLU N -53.00 -29.00 -52.33 -53.77 -49.17 0.77 16 0 "[ . 1 . 2]"
93 . 1 80 GLN C 1 81 ARG N 1 81 ARG CA 1 81 ARG C -72.00 -52.00 -64.16 -66.58 -59.92 . . 0 "[ . 1 . 2]"
94 . 1 82 GLU N 1 82 GLU CA 1 82 GLU C 1 83 THR N -49.00 -29.00 -50.46 -51.02 -49.84 2.02 9 0 "[ . 1 . 2]"
95 . 1 81 ARG C 1 82 GLU N 1 82 GLU CA 1 82 GLU C -72.00 -52.00 -55.32 -54.63 -55.08 . . 0 "[ . 1 . 2]"
96 . 1 83 THR N 1 83 THR CA 1 83 THR C 1 84 ILE N -48.00 -36.00 -49.92 -50.04 -50.17 3.05 15 0 "[ . 1 . 2]"
97 . 1 82 GLU C 1 83 THR N 1 83 THR CA 1 83 THR C -74.00 -54.00 -61.39 -61.19 -61.33 . . 0 "[ . 1 . 2]"
98 . 1 84 ILE N 1 84 ILE CA 1 84 ILE C 1 85 PHE N -61.00 -21.00 -31.50 -32.13 -32.50 . . 0 "[ . 1 . 2]"
99 . 1 83 THR C 1 84 ILE N 1 84 ILE CA 1 84 ILE C -92.00 -48.00 -67.90 -67.81 -67.90 . . 0 "[ . 1 . 2]"
100 . 1 85 PHE N 1 85 PHE CA 1 85 PHE C 1 86 SER N -57.00 7.00 -36.22 -43.09 -22.52 . . 0 "[ . 1 . 2]"
101 . 1 84 ILE C 1 85 PHE N 1 85 PHE CA 1 85 PHE C -93.00 -45.00 -77.40 -76.47 -76.67 . . 0 "[ . 1 . 2]"
102 . 1 86 SER N 1 86 SER CA 1 86 SER C 1 87 ARG N -63.00 25.00 -22.22 -14.19 -15.35 . . 0 "[ . 1 . 2]"
103 . 1 85 PHE C 1 86 SER N 1 86 SER CA 1 86 SER C -114.00 -38.00 -86.13 -87.40 -87.83 . . 0 "[ . 1 . 2]"
104 . 1 92 VAL N 1 92 VAL CA 1 92 VAL C 1 93 THR N 109.00 147.00 145.46 136.15 149.20 2.20 14 0 "[ . 1 . 2]"
105 . 1 91 PRO C 1 92 VAL N 1 92 VAL CA 1 92 VAL C -136.00 -60.00 -119.30 -137.92 -73.92 1.92 14 0 "[ . 1 . 2]"
106 . 1 93 THR N 1 93 THR CA 1 93 THR C 1 94 PHE N 104.00 156.00 137.80 124.31 150.29 . . 0 "[ . 1 . 2]"
107 . 1 92 VAL C 1 93 THR N 1 93 THR CA 1 93 THR C -128.00 -84.00 -89.53 -102.45 -81.39 2.61 14 0 "[ . 1 . 2]"
108 . 1 94 PHE N 1 94 PHE CA 1 94 PHE C 1 95 VAL N 119.00 159.00 142.00 137.40 148.44 . . 0 "[ . 1 . 2]"
109 . 1 93 THR C 1 94 PHE N 1 94 PHE CA 1 94 PHE C -140.00 -104.00 -121.88 -120.69 -123.00 . . 0 "[ . 1 . 2]"
110 . 1 95 VAL N 1 95 VAL CA 1 95 VAL C 1 96 PHE N 97.00 147.00 105.85 98.96 112.95 . . 0 "[ . 1 . 2]"
111 . 1 94 PHE C 1 95 VAL N 1 95 VAL CA 1 95 VAL C -148.00 -75.00 -96.65 -102.05 -106.03 . . 0 "[ . 1 . 2]"
112 . 1 96 PHE N 1 96 PHE CA 1 96 PHE C 1 97 PRO N 79.00 163.00 149.00 139.36 152.32 . . 0 "[ . 1 . 2]"
113 . 1 95 VAL C 1 96 PHE N 1 96 PHE CA 1 96 PHE C -163.00 -55.00 -91.20 -92.08 -94.37 . . 0 "[ . 1 . 2]"
114 . 1 104 ARG N 1 104 ARG CA 1 104 ARG C 1 105 TRP N -36.00 56.00 -1.94 -14.70 6.90 . . 0 "[ . 1 . 2]"
115 . 1 106 LEU N 1 106 LEU CA 1 106 LEU C 1 107 THR N -82.00 10.00 -24.86 -19.60 -21.28 . . 0 "[ . 1 . 2]"
116 . 1 105 TRP C 1 106 LEU N 1 106 LEU CA 1 106 LEU C -105.00 -49.00 -76.09 -86.56 -67.23 . . 0 "[ . 1 . 2]"
117 . 1 107 THR N 1 107 THR CA 1 107 THR C 1 108 GLY N -39.00 54.00 -40.56 -40.96 -41.40 4.85 15 0 "[ . 1 . 2]"
118 . 1 106 LEU C 1 107 THR N 1 107 THR CA 1 107 THR C -142.00 -70.00 -142.40 -143.28 -143.81 3.99 11 0 "[ . 1 . 2]"
119 . 1 108 GLY N 1 108 GLY CA 1 108 GLY C 1 109 ARG N -20.00 40.00 -0.98 -19.28 24.06 . . 0 "[ . 1 . 2]"
120 . 1 112 SER N 1 112 SER CA 1 112 SER C 1 113 LEU N 130.00 174.00 146.47 145.04 129.49 3.98 1 0 "[ . 1 . 2]"
121 . 1 111 ASP C 1 112 SER N 1 112 SER CA 1 112 SER C -168.00 -108.00 -160.43 -163.57 -166.33 1.15 1 0 "[ . 1 . 2]"
122 . 1 113 LEU N 1 113 LEU CA 1 113 LEU C 1 114 ALA N 110.00 142.00 135.62 134.96 129.04 5.58 10 1 "[ . + . 2]"
123 . 1 112 SER C 1 113 LEU N 1 113 LEU CA 1 113 LEU C -169.00 -97.00 -150.52 -169.34 -117.01 0.34 10 0 "[ . 1 . 2]"
124 . 1 114 ALA N 1 114 ALA CA 1 114 ALA C 1 115 VAL N 114.00 162.00 126.14 130.35 127.97 1.79 15 0 "[ . 1 . 2]"
125 . 1 115 VAL N 1 115 VAL CA 1 115 VAL C 1 116 ARG N 132.00 176.00 156.85 151.18 163.79 . . 0 "[ . 1 . 2]"
126 . 1 114 ALA C 1 115 VAL N 1 115 VAL CA 1 115 VAL C -165.00 -113.00 -146.38 -156.61 -141.29 . . 0 "[ . 1 . 2]"
127 . 1 116 ARG N 1 116 ARG CA 1 116 ARG C 1 117 VAL N 121.00 162.00 155.97 152.55 150.71 0.16 15 0 "[ . 1 . 2]"
128 . 1 115 VAL C 1 116 ARG N 1 116 ARG CA 1 116 ARG C -169.00 -117.00 -146.06 -155.99 -139.77 . . 0 "[ . 1 . 2]"
129 . 1 116 ARG C 1 117 VAL N 1 117 VAL CA 1 117 VAL C -139.00 -94.00 -121.66 -119.97 -120.50 . . 0 "[ . 1 . 2]"
130 . 1 118 THR N 1 118 THR CA 1 118 THR C 1 119 ASP N 107.00 163.00 140.63 138.32 134.96 . . 0 "[ . 1 . 2]"
131 . 1 117 VAL C 1 118 THR N 1 118 THR CA 1 118 THR C -163.00 -83.00 -134.54 -141.64 -128.65 . . 0 "[ . 1 . 2]"
132 . 1 122 LEU N 1 122 LEU CA 1 122 LEU C 1 123 VAL N -66.00 22.00 -5.46 -7.51 -4.09 . . 0 "[ . 1 . 2]"
133 . 1 121 PRO C 1 122 LEU N 1 122 LEU CA 1 122 LEU C -90.00 -46.00 -78.20 -76.94 -77.30 . . 0 "[ . 1 . 2]"
134 . 1 123 VAL N 1 123 VAL CA 1 123 VAL C 1 124 VAL N -57.00 -29.00 -45.28 -45.07 -45.23 . . 0 "[ . 1 . 2]"
135 . 1 122 LEU C 1 123 VAL N 1 123 VAL CA 1 123 VAL C -71.00 -51.00 -57.85 -57.22 -57.46 . . 0 "[ . 1 . 2]"
136 . 1 124 VAL N 1 124 VAL CA 1 124 VAL C 1 125 ALA N -61.00 -29.00 -62.13 -62.73 -61.49 1.73 7 0 "[ . 1 . 2]"
137 . 1 123 VAL C 1 124 VAL N 1 124 VAL CA 1 124 VAL C -71.00 -51.00 -53.30 -55.24 -51.01 . . 0 "[ . 1 . 2]"
138 . 1 125 ALA N 1 125 ALA CA 1 125 ALA C 1 126 LEU N -51.00 -19.00 -44.26 -44.81 -45.41 . . 0 "[ . 1 . 2]"
139 . 1 124 VAL C 1 125 ALA N 1 125 ALA CA 1 125 ALA C -95.00 -43.00 -41.32 -41.97 -40.44 2.56 16 0 "[ . 1 . 2]"
140 . 1 126 LEU N 1 126 LEU CA 1 126 LEU C 1 127 CYS N -51.00 -39.00 -48.67 -51.54 -47.09 0.54 19 0 "[ . 1 . 2]"
141 . 1 125 ALA C 1 126 LEU N 1 126 LEU CA 1 126 LEU C -71.00 -55.00 -68.90 -70.16 -66.33 . . 0 "[ . 1 . 2]"
142 . 1 127 CYS N 1 127 CYS CA 1 127 CYS C 1 128 GLN N -54.00 -30.00 -48.78 -49.33 -49.54 . . 0 "[ . 1 . 2]"
143 . 1 126 LEU C 1 127 CYS N 1 127 CYS CA 1 127 CYS C -70.00 -50.00 -70.13 -70.00 -70.22 0.66 12 0 "[ . 1 . 2]"
144 . 1 128 GLN N 1 128 GLN CA 1 128 GLN C 1 129 ALA N -55.00 -27.00 -42.25 -43.27 -41.61 . . 0 "[ . 1 . 2]"
145 . 1 127 CYS C 1 128 GLN N 1 128 GLN CA 1 128 GLN C -74.00 -58.00 -54.70 -54.41 -54.55 4.07 7 0 "[ . 1 . 2]"
146 . 1 129 ALA N 1 129 ALA CA 1 129 ALA C 1 130 TYR N -55.00 5.00 -55.26 -55.66 -56.09 2.22 10 0 "[ . 1 . 2]"
147 . 1 128 GLN C 1 129 ALA N 1 129 ALA CA 1 129 ALA C -81.00 -52.00 -58.97 -58.50 -58.60 . . 0 "[ . 1 . 2]"
148 . 1 130 TYR N 1 130 TYR CA 1 130 TYR C 1 131 GLY N -38.00 50.00 -23.61 -21.67 -21.84 . . 0 "[ . 1 . 2]"
149 . 1 129 ALA C 1 130 TYR N 1 130 TYR CA 1 130 TYR C -135.00 -59.00 -62.87 -62.62 -63.00 . . 0 "[ . 1 . 2]"
150 . 1 134 LEU N 1 134 LEU CA 1 134 LEU C 1 135 VAL N 124.00 -164.00 123.25 122.36 125.36 1.64 5 0 "[ . 1 . 2]"
151 . 1 133 PRO C 1 134 LEU N 1 134 LEU CA 1 134 LEU C 178.00 -82.00 -130.72 -133.44 -134.47 . . 0 "[ . 1 . 2]"
152 . 1 135 VAL N 1 135 VAL CA 1 135 VAL C 1 136 SER N 116.00 168.00 145.98 152.99 147.87 . . 0 "[ . 1 . 2]"
153 . 1 134 LEU C 1 135 VAL N 1 135 VAL CA 1 135 VAL C -125.00 -29.00 -64.90 -63.79 -63.88 . . 0 "[ . 1 . 2]"
154 . 1 136 SER N 1 136 SER CA 1 136 SER C 1 137 THR N 94.00 158.00 125.10 132.86 129.53 . . 0 "[ . 1 . 2]"
155 . 1 135 VAL C 1 136 SER N 1 136 SER CA 1 136 SER C 172.00 -44.00 -117.36 -130.12 -108.82 . . 0 "[ . 1 . 2]"
156 . 1 137 THR N 1 137 THR CA 1 137 THR C 1 138 SER N 76.00 168.00 161.31 164.23 163.82 . . 0 "[ . 1 . 2]"
157 . 1 136 SER C 1 137 THR N 1 137 THR CA 1 137 THR C -157.00 -85.00 -131.74 -136.20 -127.72 . . 0 "[ . 1 . 2]"
158 . 1 150 VAL N 1 150 VAL CA 1 150 VAL C 1 151 ASP N -60.00 -16.00 -20.16 -23.92 -15.75 0.25 18 0 "[ . 1 . 2]"
159 . 1 149 THR C 1 150 VAL N 1 150 VAL CA 1 150 VAL C -79.00 -51.00 -57.69 -58.04 -58.60 . . 0 "[ . 1 . 2]"
160 . 1 151 ASP N 1 151 ASP CA 1 151 ASP C 1 152 GLU N -52.00 -24.00 -32.41 -36.67 -23.73 0.27 15 0 "[ . 1 . 2]"
161 . 1 150 VAL C 1 151 ASP N 1 151 ASP CA 1 151 ASP C -76.00 -52.00 -64.73 -63.83 -64.21 . . 0 "[ . 1 . 2]"
162 . 1 152 GLU N 1 152 GLU CA 1 152 GLU C 1 153 VAL N -76.00 0.00 -76.46 -80.45 -70.56 4.45 8 0 "[ . 1 . 2]"
163 . 1 151 ASP C 1 152 GLU N 1 152 GLU CA 1 152 GLU C -83.00 -51.00 -62.78 -63.76 -68.99 . . 0 "[ . 1 . 2]"
164 . 1 152 GLU C 1 153 VAL N 1 153 VAL CA 1 153 VAL C -89.00 -37.00 -40.80 -50.02 -34.67 2.33 16 0 "[ . 1 . 2]"
165 . 1 154 ARG N 1 154 ARG CA 1 154 ARG C 1 155 ALA N -53.00 -25.00 -49.11 -53.27 -43.34 0.27 7 0 "[ . 1 . 2]"
166 . 1 153 VAL C 1 154 ARG N 1 154 ARG CA 1 154 ARG C -81.00 -49.00 -76.37 -70.68 -71.59 3.42 5 0 "[ . 1 . 2]"
167 . 1 155 ALA N 1 155 ALA CA 1 155 ALA C 1 156 GLN N -62.00 -18.00 -29.10 -18.61 -19.41 1.07 14 0 "[ . 1 . 2]"
168 . 1 154 ARG C 1 155 ALA N 1 155 ALA CA 1 155 ALA C -76.00 -52.00 -64.23 -72.01 -51.94 0.06 18 0 "[ . 1 . 2]"
169 . 1 156 GLN N 1 156 GLN CA 1 156 GLN C 1 157 PHE N -58.00 -14.00 -46.22 -45.63 -45.93 . . 0 "[ . 1 . 2]"
170 . 1 155 ALA C 1 156 GLN N 1 156 GLN CA 1 156 GLN C -82.00 -50.00 -82.84 -84.23 -80.74 2.23 14 0 "[ . 1 . 2]"
171 . 1 157 PHE N 1 157 PHE CA 1 157 PHE C 1 158 GLY N -35.00 49.00 -29.69 -37.24 -18.05 2.24 10 0 "[ . 1 . 2]"
172 . 1 156 GLN C 1 157 PHE N 1 157 PHE CA 1 157 PHE C -130.00 -62.00 -121.06 -131.11 -106.07 1.11 2 0 "[ . 1 . 2]"
173 . 1 158 GLY C 1 159 ALA N 1 159 ALA CA 1 159 ALA C -80.00 -44.00 -43.34 -43.12 -43.23 1.79 8 0 "[ . 1 . 2]"
174 . 1 163 VAL N 1 163 VAL CA 1 163 VAL C 1 164 VAL N 85.00 165.00 167.30 167.17 167.01 3.22 8 0 "[ . 1 . 2]"
175 . 1 164 VAL N 1 164 VAL CA 1 164 VAL C 1 165 PRO N 58.00 170.00 65.40 66.14 65.96 . . 0 "[ . 1 . 2]"
176 . 1 163 VAL C 1 164 VAL N 1 164 VAL CA 1 164 VAL C -176.00 -40.00 -123.50 -125.15 -121.51 . . 0 "[ . 1 . 2]"
177 . 1 175 SER C 1 176 GLU N 1 176 GLU CA 1 176 GLU C -149.00 -77.00 -116.57 -116.96 -126.11 . . 0 "[ . 1 . 2]"
178 . 1 177 ILE N 1 177 ILE CA 1 177 ILE C 1 178 ARG N 105.00 145.00 129.46 120.50 102.50 2.50 1 0 "[ . 1 . 2]"
179 . 1 176 GLU C 1 177 ILE N 1 177 ILE CA 1 177 ILE C -130.00 -88.00 -105.92 -113.12 -117.61 0.92 19 0 "[ . 1 . 2]"
180 . 1 178 ARG N 1 178 ARG CA 1 178 ARG C 1 179 ASP N 116.00 176.00 165.25 161.43 158.51 . . 0 "[ . 1 . 2]"
181 . 1 177 ILE C 1 178 ARG N 1 178 ARG CA 1 178 ARG C -150.00 -91.00 -128.12 -137.80 -95.53 . . 0 "[ . 1 . 2]"
182 . 1 179 ASP N 1 179 ASP CA 1 179 ASP C 1 180 ALA N 107.00 143.00 106.17 106.68 106.48 2.57 16 0 "[ . 1 . 2]"
183 . 1 178 ARG C 1 179 ASP N 1 179 ASP CA 1 179 ASP C -164.00 -20.00 -79.41 -87.25 -72.03 . . 0 "[ . 1 . 2]"
184 . 1 184 GLU C 1 185 LEU N 1 185 LEU CA 1 185 LEU C -109.00 -65.00 -81.63 -108.78 -64.95 0.05 12 0 "[ . 1 . 2]"
185 . 1 185 LEU C 1 186 PHE N 1 186 PHE CA 1 186 PHE C -130.00 -86.00 -107.01 -87.95 -91.75 1.03 2 0 "[ . 1 . 2]"
186 . 1 186 PHE C 1 187 ARG N 1 187 ARG CA 1 187 ARG C -156.00 -71.00 -86.62 -74.66 -77.94 0.93 11 0 "[ . 1 . 2]"
187 . 1 187 ARG C 1 188 GLN N 1 188 GLN CA 1 188 GLN C -180.00 -56.00 -138.91 -174.09 -65.67 . . 0 "[ . 1 . 2]"
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